Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 8/20 | 0.57 |
| ▸ | HRH1 | P35367 | 8/20 | 0.57 |
| ▸ | ADRA1B | P35368 | 8/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10482471 | 0.89 | ADRA1A (0.61) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL10700164 | 0.86 | ADRA1A (0.55) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL10700300 | 0.80 | ADRA1A (0.55) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| Talastine SCHEMBL29350005 | 0.79 | ADRA1A (0.81) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| Talastine SCHEMBL30502 | 0.79 | ADRA1A (0.81) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL10698694 | 0.79 | ADRA1A (0.62) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL10700979 | 0.78 | HRH1 (0.65) | ADRA1AHRH1ADRA1BHRH3KCNH2 | |
| Talastine SCHEMBL1650995 | 0.77 | ADRA1A (0.78) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL7884616 | 0.76 | TSHR (0.52) | ADRA1AHRH1ADRA1BTSHRHRH3 | |
| SCHEMBL7894969 | 0.74 | TSHR (0.66) | ADRA1AHRH1ADRA1BTSHRGLA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0289881-A2 | 2-Aminoalkyl-4-benzyl-1-(2H)-phthalazinone derivatives | ASTA Medica Aktiengesellschaft (DE) | 1988-11-09 | — | — | EP | disclosed |